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(3,4,7-trimethyl-2-oxochromen-5-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

(3,4,7-trimethyl-2-oxochromen-5-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate structure

CAS No:
956181-15-0
Formula:
C23H31NO6
Chemical Name:
(3,4,7-trimethyl-2-oxochromen-5-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
Synonyms:
ZINC2093528;STL462452;AKOS016362589;MCULE-4264394887;3,4,7-trimethyl-2-oxo-2H-chromen-5-yl N-(tert-butoxycarbonyl)-L-isoleucinate;(2S,3R)-3,4,7-trimethyl-2-oxo-2H-chromen-5-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate;956181-15-0

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(3,4,7-trimethyl-2-oxochromen-5-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Basic Attributes

Molecular Weight：

417.5 g/mol

Exact Mass：

417.21513771 g/mol

Characteristics

PSA：

90.9 Å²

Computed Properties

Molecular Weight:417.5
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:417.21513771
Monoisotopic Mass:417.21513771
Topological Polar Surface Area:90.9
Heavy Atom Count:30
Complexity:707
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3,4,7-trimethyl-2-oxochromen-5-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Basic Attributes
Characteristics
Computed Properties
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